5058-13-9

Name Columbianadin
CAS 5058-13-9
Molecular Formula C19H20O5
MDL Number MFCD07781426
Molecular Weight 328.36
MOL File 5058-13-9.mol
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Chemical Properties

Melting point  117.0 to 121.0 °C
Boiling point  482.3±45.0 °C(Predicted)
density  1.232±0.06 g/cm3(Predicted)
solubility  DMSO : 33.33 mg/mL (101.50 mM; Need ultrasonic)H2O : < 0.1 mg/mL (insoluble)
form  powder to crystal
color  White to Almost white
InChI InChI=1S/C19H20O5/c1-5-11(2)18(21)24-19(3,4)15-10-13-14(22-15)8-6-12-7-9-16(20)23-17(12)13/h5-9,15H,10H2,1-4H3/b11-5-/t15-/m0/s1
InChIKey JRIBPWOXWIRQOQ-GHAIFCDISA-N
SMILES C(OC([C@H]1OC2C=CC3=C(C=2C1)OC(=O)C=C3)(C)C)(=O)/C(/C)=C\C

Safety Data

Safety Statements 
HS Code  29329990

Hazard Information

Spectrum Detail

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